5-bromanyl-2-[2-(4-chloranyl-3-methyl-phenoxy)ethylamino]benzoic acid

Systemtic Name: 5-bromanyl-2-[2-(4-chloranyl-3-methyl-phenoxy)ethylamino]benzoic acid Openeye Name: 5-bromo-2-[2-(4-chloro-3-methyl-phenoxy)ethylamino]benzoic acid CAS Name: 5-bromo-2-[2-(4-chloro-3-methylphenoxy)ethylamino]benzoic acid IUPAC Name: 5-bromo-2-[2-(4-chloro-3-methylphenoxy)ethylamino]benzoic acid Traditional Name: 5-bromo-2-[2-(4-chloro-3-methyl-phenoxy)ethylamino]benzoic acid Formula: C16H15BrClNO3 MolecularWeight: 384.6522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCCNC2=C(C=C(C=C2)Br)C(=O)O)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OCCNC2=C(C=C(C=C2)Br)C(=O)O)Cl

InChI

InChI=1S/C16H15BrClNO3/c1-10-8-12(3-4-14(10)18)22-7-6-19-15-5-2-11(17)9-13(15)16(20)21/h2-5,8-9,19H,6-7H2,1H3,(H,20,21)